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Pantothenic Acid

CAS 79-83-4C9H17NO5MW 219.23

Pantothenic Acid (CAS 79-83-4) — formula C9H17NO5, molecular weight 219.23; category organic chemicals.

Specifications

CAS Number79-83-4
Molecular FormulaC9H17NO5
Molecular Weight219.23
Melting Point< 25 °C
LogP-1.69
CategoryOrganic Chemicals|Nutrition Enhancers

Purchase Profile

What this product is

Pantothenic Acid is a carbon-based organic compound with CAS registry number 79-83-4 and molecular formula C9H17NO5 (molecular weight 219.23), belonging to the organic chemicals segment of chemical raw materials.

Identification

CAS number: 79-83-4

Its molecular formula C9H17NO5 comprises 9 C, 17 H, 1 N, 5 O atoms.

Also known as: Pantothenic Acid · Vitamin B5

Category: organic chemicals / food additives

Frequently Asked Questions

What is the CAS number of Pantothenic Acid?

The CAS registry number of Pantothenic Acid is 79-83-4.

What is the molecular formula and molecular weight of Pantothenic Acid?

Molecular formula C9H17NO5, molecular weight 219.23.

What other names is Pantothenic Acid known by?

It is also registered under: Pantothenic Acid, Vitamin B5.

Which category does Pantothenic Acid belong to?

Category: Organic Chemicals / Nutrition Enhancers.

PubChem Public Data

Public-database records for Pantothenic Acid (CAS 79-83-4), reproduced here for independent cross-checking.

Safety classification and hazard statements

GHS notification summary100% (3 / 3)

This chemical does not meet GHS hazard criteria for 100% (3 of 3) of all reports.

Reported as not meeting GHS hazard criteria by 3 of 3 companies. For more detailed information, please visit ECHA C&L website.

Regulatory listings

Regulatory & Food ContactCIR / INCI: Cosmetic ingredients (Pantothenic Acid) -> CIR (Cosmetic Ingredient Review)
CIR / INCI: Antistatic; Skin conditioning; Hair conditioning
GHS notification summary100% (3 / 3)

Physical description and handling notes

  • Viscous liquid; Unstable and extremely hygroscopic; [Merck Index]
  • Solid
  • Yellow viscous oil
  • Viscous oil
  • Viscous hygroscopic liquid
  • 195ºC (D-Calcium Pantothenate salt)

Reported physical properties

熔点< 25 °C
溶解度1000.0 mg/mL
LogP-1.69
Collision Cross Section146.6 Ų [M-H]-
Collision Cross Section150.8 Ų [M+Na]+
Collision Cross Section129.8 Ų [M+H]+
Collision Cross Section203 Ų [M+H]+

How this substance is indexed

CAS Registry Number79-83-4
PubChem CID6613
分子式C9H17NO5
IUPAC 名称3-[[(2R)-2,4-dihydroxy-3,3-dimethylbutanoyl]amino]propanoic acid
UNII(FDA)19F5HK2737

Documented uses

  • CIR ingredient: Pantothenic Acid
  • ... Commonly included in multivitamin preparations and in products for enteral and parenteral alimentation.
  • Food additive /Sodium pantothenate/
  • BIOLOGICAL ACTIVITIES: Antiallergic; antiarthritic; antiephalagic; possible anticlaudificant; antidermatitic; antifatigue; antihypercholesterolemic; possible antiielus; possible antiinsomniac; possible antirheumatitic; cancer-preventive
  • THERAPEUTIC CATEGORY (VETERINARY): Nutritional factor: dietary essential except in horses, ruminants
  • Use (kg; approx.) in Germany (2009): >1000

Names this substance appears under

pantothenic acid; D-pantothenic acid; 79-83-4; vitamin B5; Chick antidermatitis factor; (+)-Pantothenic acid; Vitamin B-5; Kyselina pantothenova; D(+)-N-(2,4-Dihydroxy-3,3-dimethylbutyryl)-beta-alanine; Pantothenic acid (d); 3-[[(2R)-2,4-dihydroxy-3,3-dimethylbutanoyl]amino]propanoic acid; (D,+)-N(alpha-gamma-Dihydroxy-beta,beta-dimethylbutyryl)-beta-alanine; beta-Alanine, N-(2,4-dihydroxy-3,3-dimethyl-1-oxobutyl)-, (R)-; N-(2,4-Dihydroxy-3,3-dimethylbutyryl)-beta-alanine; 19F5HK2737; DTXSID9023417

Computed molecular descriptors

分子量219.23
XLogP3-1.1
氢键供体数4
氢键受体数5
可旋转键数6
精确质量219.11067264
单同位素质量219.11067264
拓扑极性表面积107
重原子数15
形式电荷0

Database abstract

Pantothenic Acid · CAS 79-83-4 · C9H17NO5. UNII 19F5HK2737. 熔点: < 25 °C; 溶解度: 1000.0 mg/mL; LogP: -1.69.

Source: PubChem / Wikidata; the batch COA governs where values differ.

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